2-[(2,5-dimethyl-4-phenylazanylperoxysulfanyl-phenyl)diazenyl]-3-oxidanylidene-N-(2,4,5-trimethylphenyl)butanamide

Systemtic Name: 2-[(2,5-dimethyl-4-phenylazanylperoxysulfanyl-phenyl)diazenyl]-3-oxidanylidene-N-(2,4,5-trimethylphenyl)butanamide Openeye Name: 2-(4-anilinoperoxysulfanyl-2,5-dimethyl-phenyl)azo-3-oxo-N-(2,4,5-trimethylphenyl)butanamide CAS Name: 4-[1,3-dioxo-1-(2,4,5-trimethylanilino)butan-2-yl]azo-2,5-dimethylbenzenesulfenic acid anilinooxy ester IUPAC Name: 2-[(4-anilinoperoxysulfanyl-2,5-dimethylphenyl)diazenyl]-3-oxo-N-(2,4,5-trimethylphenyl)butanamide Traditional Name: 2-[4-(anilinoperoxythio)-2,5-dimethyl-phenyl]azo-3-keto-N-(2,4,5-trimethylphenyl)butyramide Formula: C27H30N4O4S MolecularWeight: 506.6165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=O)C(C(=O)C)N=NC2=C(C=C(C(=C2)C)SOONC3=CC=CC=C3)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=O)C(C(=O)C)N=NC2=C(C=C(C(=C2)C)SOONC3=CC=CC=C3)C)C

InChI

InChI=1S/C27H30N4O4S/c1-16-12-18(3)23(13-17(16)2)28-27(33)26(21(6)32)30-29-24-14-20(5)25(15-19(24)4)36-35-34-31-22-10-8-7-9-11-22/h7-15,26,31H,1-6H3,(H,28,33)